Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SERPINE1 | P05121 | 2/20 | 0.56 |
| ▸ | DHODH | Q02127 | 8/20 | 0.49 |
| ▸ | BRAF | P15056 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | PKM | P14618 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | GMNN | O75496 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TTR | P02766 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.45 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL22452640 | 0.91 | SERPINE1 (0.49) | SERPINE1BRAFMEN1KMT2APKM | |
| SCHEMBL22453062 | 0.89 | DHODH (0.52) | SERPINE1DHODHMEN1KMT2APKM | |
| SCHEMBL22453063 | 0.87 | SERPINE1 (0.60) | SERPINE1DHODHMEN1KMT2APKM | |
| SCHEMBL22453347 | 0.81 | SERPINE1 (0.58) | SERPINE1DHODHMEN1KMT2ALMNA | |
| SCHEMBL22453382 | 0.81 | SERPINE1 (0.58) | SERPINE1DHODHMEN1KMT2ALMNA | |
| SCHEMBL22452646 | 0.79 | SERPINE1 (0.50) | SERPINE1MEN1KMT2APKMLMNA | |
| SCHEMBL22452767 | 0.79 | SERPINE1 (0.58) | SERPINE1DHODHMEN1KMT2APKM | |
| SCHEMBL22453374 | 0.76 | SMN1; SMN2 (0.66) | SERPINE1MEN1KMT2AALDH1A1RAB9A | |
| SCHEMBL22452796 | 0.76 | SERPINE1 (0.48) | SERPINE1MEN1KMT2ALMNAALDH1A1 | |
| SCHEMBL22453284 | 0.74 | SIRT2 (0.60) | SERPINE1MEN1KMT2APKMALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020190774-A1 | NOVEL SMALL MOLECULE INHIBITORS OF TEAD TRANSCRIPTION FACTORS | THE GENERAL HOSPITAL CORPORATION (US) | 2020-09-24 | — | — | WO | disclosed |